3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol

C14H20O — CID 63823202

IUPAC3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol
SMILESCC(C)Cc1ccc2c(c1)C(O)CC2C
InChIInChI=1S/C14H20O/c1-9(2)6-11-4-5-12-10(3)7-14(15)13(12)8-11/h4-5,8-10,14-15H,6-7H2,1-3H3
InChIKeyPYFVWMUWJAREKS-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.43
Rot. Bonds2

About 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol

3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol (PubChem CID 63823202) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol
PubChem CID63823202
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol
SMILESCC(C)Cc1ccc2c(c1)C(O)CC2C
InChIInChI=1S/C14H20O/c1-9(2)6-11-4-5-12-10(3)7-14(15)13(12)8-11/h4-5,8-10,14-15H,6-7H2,1-3H3
InChIKeyPYFVWMUWJAREKS-UHFFFAOYSA-N
XLogP3.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol (CID 63823202) is 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol is CC(C)Cc1ccc2c(c1)C(O)CC2C.
What is the InChIKey of 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol?
The InChIKey is PYFVWMUWJAREKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-9(2)6-11-4-5-12-10(3)7-14(15)13(12)8-11/h4-5,8-10,14-15H,6-7H2,1-3H3.
What are the key properties of 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol?
3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.43, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(2-methylpropyl)-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 63823202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).